CID 20426557

1-cyclopropyl-3-(methylamino)propan-1-ol

Structural Information

Molecular Formula
C7H15NO
SMILES
CNCCC(C1CC1)O
InChI
InChI=1S/C7H15NO/c1-8-5-4-7(9)6-2-3-6/h6-9H,2-5H2,1H3
InChIKey
NATIXTVGBXIWGU-UHFFFAOYSA-N
Compound name
1-cyclopropyl-3-(methylamino)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

129.11537 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 126.6
[M+Na]+ 152.104588 134.0
[M-H]- 128.108094 129.9
[M+NH4]+ 147.149193 143.0
[M+K]+ 168.078528 132.0
[M+H-H2O]+ 112.112630 121.0
[M+HCOO]- 174.113571 149.4
[M+CH3COO]- 188.129221 177.2
[M+Na-2H]- 150.090036 132.5
[M]+ 129.11482142 127.8
[M]- 129.11591858 127.8
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

patents stripe