CID 111270

7179-95-5

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1(CCCO1)CNC
InChI
InChI=1S/C7H15NO/c1-7(6-8-2)4-3-5-9-7/h8H,3-6H2,1-2H3
InChIKey
CWQAYJVEMMQWGM-UHFFFAOYSA-N
Compound name
N-methyl-1-(2-methyloxolan-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

129.11537 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.122646 127.0
[M+Na]+ 152.104588 133.0
[M-H]- 128.108094 130.8
[M+NH4]+ 147.149193 151.0
[M+K]+ 168.078528 133.8
[M+H-H2O]+ 112.112630 122.5
[M+HCOO]- 174.113571 150.2
[M+CH3COO]- 188.129221 172.4
[M+Na-2H]- 150.090036 134.5
[M]+ 129.11482142 125.4
[M]- 129.11591858 125.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe