CID 138991268

2309431-68-1

Structural Information

Molecular Formula
C14H21NO
SMILES
C[C@H](CC1=CC2=C(C=C1)OC(CC2)(C)C)N
InChI
InChI=1S/C14H21NO/c1-10(15)8-11-4-5-13-12(9-11)6-7-14(2,3)16-13/h4-5,9-10H,6-8,15H2,1-3H3/t10-/m1/s1
InChIKey
ZLPOROHPVJZTNB-SNVBAGLBSA-N
Compound name
(2R)-1-(2,2-dimethyl-3,4-dihydrochromen-6-yl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.16231 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.16959 152.1
[M+Na]+ 242.15153 158.6
[M-H]- 218.15503 156.5
[M+NH4]+ 237.19613 172.1
[M+K]+ 258.12547 157.0
[M+H-H2O]+ 202.15957 146.2
[M+HCOO]- 264.16051 170.7
[M+CH3COO]- 278.17616 193.4
[M+Na-2H]- 240.13698 157.4
[M]+ 219.16176 150.5
[M]- 219.16286 150.5
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.