CID 7064087

N,n-diethyl-2,3-dihydro-1h-indole-5-sulfonamide

Structural Information

Molecular Formula
C12H18N2O2S
SMILES
CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)NCC2
InChI
InChI=1S/C12H18N2O2S/c1-3-14(4-2)17(15,16)11-5-6-12-10(9-11)7-8-13-12/h5-6,9,13H,3-4,7-8H2,1-2H3
InChIKey
LDAUEKPMNUEUGU-UHFFFAOYSA-N
Compound name
N,N-diethyl-2,3-dihydro-1H-indole-5-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

254.1089 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.116176 157.3
[M+Na]+ 277.098118 164.6
[M-H]- 253.101624 160.4
[M+NH4]+ 272.142723 176.2
[M+K]+ 293.072058 161.5
[M+H-H2O]+ 237.106160 151.3
[M+HCOO]- 299.107101 172.9
[M+CH3COO]- 313.122751 194.1
[M+Na-2H]- 275.083566 160.3
[M]+ 254.10835142 159.4
[M]- 254.10944858 159.4
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