CID 43477039

1-cyclopropyl-1h-pyrrole-2-carboxylic acid

Structural Information

Molecular Formula
C8H9NO2
SMILES
C1CC1N2C=CC=C2C(=O)O
InChI
InChI=1S/C8H9NO2/c10-8(11)7-2-1-5-9(7)6-3-4-6/h1-2,5-6H,3-4H2,(H,10,11)
InChIKey
VDFAGHFIPYSSIU-UHFFFAOYSA-N
Compound name
1-cyclopropylpyrrole-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

151.06332 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.070596 130.3
[M+Na]+ 174.052538 140.4
[M-H]- 150.056044 135.6
[M+NH4]+ 169.097143 146.3
[M+K]+ 190.026478 137.2
[M+H-H2O]+ 134.060580 124.0
[M+HCOO]- 196.061521 153.0
[M+CH3COO]- 210.077171 175.7
[M+Na-2H]- 172.037986 134.7
[M]+ 151.06277142 132.2
[M]- 151.06386858 132.2
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