CID 115011214

4-methoxy-3,3-dimethylpyrrolidine

Structural Information

Molecular Formula
C7H15NO
SMILES
CC1(CNCC1OC)C
InChI
InChI=1S/C7H15NO/c1-7(2)5-8-4-6(7)9-3/h6,8H,4-5H2,1-3H3
InChIKey
ULABXABPWDXDFQ-UHFFFAOYSA-N
Compound name
4-methoxy-3,3-dimethylpyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

129.11537 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.12265 127.7
[M+Na]+ 152.10459 135.2
[M-H]- 128.10809 128.6
[M+NH4]+ 147.14919 151.7
[M+K]+ 168.07853 134.3
[M+H-H2O]+ 112.11263 123.1
[M+HCOO]- 174.11357 148.2
[M+CH3COO]- 188.12922 168.8
[M+Na-2H]- 150.09004 132.6
[M]+ 129.11482 125.4
[M]- 129.11592 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

No literature data available for this compound.

Patent stripe

patents stripe