CID 71758169

1-[1-(aminomethyl)cyclopropyl]-2-methylpropan-1-ol

Structural Information

Molecular Formula
C8H17NO
SMILES
CC(C)C(C1(CC1)CN)O
InChI
InChI=1S/C8H17NO/c1-6(2)7(10)8(5-9)3-4-8/h6-7,10H,3-5,9H2,1-2H3
InChIKey
IUNFLTXQCGMMKR-UHFFFAOYSA-N
Compound name
1-[1-(aminomethyl)cyclopropyl]-2-methylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.13101 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 130.9
[M+Na]+ 166.12023 138.3
[M-H]- 142.12373 133.9
[M+NH4]+ 161.16483 148.4
[M+K]+ 182.09417 137.0
[M+H-H2O]+ 126.12827 126.7
[M+HCOO]- 188.12921 151.5
[M+CH3COO]- 202.14486 179.8
[M+Na-2H]- 164.10568 135.2
[M]+ 143.13046 131.3
[M]- 143.13156 131.3
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.