CID 79128527

2-[1-(aminomethyl)cyclopentyl]propan-2-ol

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)(C1(CCCC1)CN)O
InChI
InChI=1S/C9H19NO/c1-8(2,11)9(7-10)5-3-4-6-9/h11H,3-7,10H2,1-2H3
InChIKey
XECXUBRGAZTIAA-UHFFFAOYSA-N
Compound name
2-[1-(aminomethyl)cyclopentyl]propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.14667 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.15395 137.5
[M+Na]+ 180.13589 142.7
[M-H]- 156.13939 138.7
[M+NH4]+ 175.18049 160.8
[M+K]+ 196.10983 141.2
[M+H-H2O]+ 140.14393 133.6
[M+HCOO]- 202.14487 157.3
[M+CH3COO]- 216.16052 175.6
[M+Na-2H]- 178.12134 142.2
[M]+ 157.14612 132.7
[M]- 157.14722 132.7
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.