CID 513039

Chembl328639

Structural Information

Molecular Formula
C14H23N
SMILES
CNCC1CC12C3CC4CC(C3)CC2C4
InChI
InChI=1S/C14H23N/c1-15-8-13-7-14(13)11-3-9-2-10(5-11)6-12(14)4-9/h9-13,15H,2-8H2,1H3
InChIKey
WLIIHQNKOABQHP-UHFFFAOYSA-N
Compound name
N-methyl-1-spiro[adamantane-2,2'-cyclopropane]-1'-ylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

205.18304 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.19032 147.6
[M+Na]+ 228.17226 151.8
[M-H]- 204.17576 146.5
[M+NH4]+ 223.21686 168.3
[M+K]+ 244.14620 147.3
[M+H-H2O]+ 188.18030 140.4
[M+HCOO]- 250.18124 154.8
[M+CH3COO]- 264.19689 156.4
[M+Na-2H]- 226.15771 157.5
[M]+ 205.18249 148.8
[M]- 205.18359 148.8
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.