CID 13751568

9-methylfluorene-9-carbonyl chloride

Structural Information

Molecular Formula
C15H11ClO
SMILES
CC1(C2=CC=CC=C2C3=CC=CC=C31)C(=O)Cl
InChI
InChI=1S/C15H11ClO/c1-15(14(16)17)12-8-4-2-6-10(12)11-7-3-5-9-13(11)15/h2-9H,1H3
InChIKey
ZQYOOHGEBHBNTP-UHFFFAOYSA-N
Compound name
9-methylfluorene-9-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

24
Patents

242.04984 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.057116 153.0
[M+Na]+ 265.039058 164.5
[M-H]- 241.042564 159.1
[M+NH4]+ 260.083663 177.6
[M+K]+ 281.012998 158.1
[M+H-H2O]+ 225.047100 148.2
[M+HCOO]- 287.048041 171.0
[M+CH3COO]- 301.063691 167.0
[M+Na-2H]- 263.024506 159.3
[M]+ 242.04929142 156.6
[M]- 242.05038858 156.6
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