CID 3070743

2-n,n-dimethylamino-4-phenylspiro(5.5)undecane hydrochloride

Structural Information

Molecular Formula
C19H29N
SMILES
CN(C)C1CC(CC2(C1)CCCCC2)C3=CC=CC=C3
InChI
InChI=1S/C19H29N/c1-20(2)18-13-17(16-9-5-3-6-10-16)14-19(15-18)11-7-4-8-12-19/h3,5-6,9-10,17-18H,4,7-8,11-15H2,1-2H3
InChIKey
MQKNRLGHBIOCCA-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-phenylspiro[5.5]undecan-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.23 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.23728 168.2
[M+Na]+ 294.21922 169.6
[M-H]- 270.22272 176.1
[M+NH4]+ 289.26382 186.2
[M+K]+ 310.19316 166.3
[M+H-H2O]+ 254.22726 159.2
[M+HCOO]- 316.22820 185.0
[M+CH3COO]- 330.24385 177.7
[M+Na-2H]- 292.20467 170.1
[M]+ 271.22945 159.4
[M]- 271.23055 159.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.